(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone

C14H14N4O2 — CID 110270857

IUPAC(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone
SMILESO=C(c1cncnc1)N1CCOC(c2ccccn2)C1
InChIInChI=1S/C14H14N4O2/c19-14(11-7-15-10-16-8-11)18-5-6-20-13(9-18)12-3-1-2-4-17-12/h1-4,7-8,10,13H,5-6,9H2
InChIKeyBRSPFTMVFRFUFA-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.09
Rot. Bonds2

About (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone

(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone (PubChem CID 110270857) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone.

Molecular Properties

Compound Name(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone
PubChem CID110270857
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone
SMILESO=C(c1cncnc1)N1CCOC(c2ccccn2)C1
InChIInChI=1S/C14H14N4O2/c19-14(11-7-15-10-16-8-11)18-5-6-20-13(9-18)12-3-1-2-4-17-12/h1-4,7-8,10,13H,5-6,9H2
InChIKeyBRSPFTMVFRFUFA-UHFFFAOYSA-N
XLogP1.09
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone?
The IUPAC name of (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone (CID 110270857) is (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone.
What is the SMILES notation for (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone?
The canonical SMILES for (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone is O=C(c1cncnc1)N1CCOC(c2ccccn2)C1.
What is the InChIKey of (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone?
The InChIKey is BRSPFTMVFRFUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c19-14(11-7-15-10-16-8-11)18-5-6-20-13(9-18)12-3-1-2-4-17-12/h1-4,7-8,10,13H,5-6,9H2.
What are the key properties of (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone?
(2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone has a molecular weight of 270.29 g/mol, XLogP of 1.09, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyridin-2-ylmorpholin-4-yl)-pyrimidin-5-ylmethanone is sourced from PubChem (CID 110270857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).